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sodium 4-(6-azanylhexadecylamino)benzoate

sodium 4-(6-azanylhexadecylamino)benzoate

Systemtic Name:sodium 4-(6-azanylhexadecylamino)benzoate
Openeye Name:sodium 4-(6-aminohexadecylamino)benzoate
CAS Name:sodium 4-(6-aminohexadecylamino)benzoate
IUPAC Name:sodium 4-(6-aminohexadecylamino)benzoate
Traditional Name:sodium 4-(6-aminohexadecylamino)benzoate
Formula: C23H39N2NaO2
MolecularWeight: 398.55773
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCNC1=CC=C(C=C1)C(=O)[O-])N.[Na+]


Isomeric SMILES

CCCCCCCCCCC(CCCCCNC1=CC=C(C=C1)C(=O)[O-])N.[Na+]


InChI

InChI=1S/C23H40N2O2.Na/c1-2-3-4-5-6-7-8-10-13-21(24)14-11-9-12-19-25-22-17-15-20(16-18-22)23(26)27;/h15-18,21,25H,2-14,19,24H2,1H3,(H,26,27);/q;+1/p-1


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